4-{[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopentylbenzamide
Chemical Structure Depiction of
4-{[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopentylbenzamide
4-{[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopentylbenzamide
Compound characteristics
| Compound ID: | G629-0167 |
| Compound Name: | 4-{[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopentylbenzamide |
| Molecular Weight: | 518.68 |
| Molecular Formula: | C29 H34 N4 O3 S |
| Smiles: | C1CCC(CC1)NC(CSC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC1CCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4357 |
| logD: | 4.4357 |
| logSw: | -4.4284 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.472 |
| InChI Key: | LGWXFFIPDDQPJP-UHFFFAOYSA-N |